5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine

C24H30N6O — CID 92617305

IUPAC5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine
SMILESCOCCc1ncc(CN2CCC(c3cc(-c4ccc(N)nc4)cc(C)n3)CC2)cn1
InChIInChI=1S/C24H30N6O/c1-17-11-21(20-3-4-23(25)26-15-20)12-22(29-17)19-5-8-30(9-6-19)16-18-13-27-24(28-14-18)7-10-31-2/h3-4,11-15,19H,5-10,16H2,1-2H3,(H2,25,26)
InChIKeyFIYGJGFHFXJBHR-UHFFFAOYSA-N
MW418.55 g/mol
LogP3.39
Rot. Bonds7

About 5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine

5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine (PubChem CID 92617305) has the molecular formula C24H30N6O and a molecular weight of 418.55 g/mol. Its IUPAC name is 5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine.

Molecular Properties

Compound Name5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine
PubChem CID92617305
Molecular FormulaC24H30N6O
Molecular Weight418.55 g/mol
Exact Mass418.25
IUPAC Name5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine
SMILESCOCCc1ncc(CN2CCC(c3cc(-c4ccc(N)nc4)cc(C)n3)CC2)cn1
InChIInChI=1S/C24H30N6O/c1-17-11-21(20-3-4-23(25)26-15-20)12-22(29-17)19-5-8-30(9-6-19)16-18-13-27-24(28-14-18)7-10-31-2/h3-4,11-15,19H,5-10,16H2,1-2H3,(H2,25,26)
InChIKeyFIYGJGFHFXJBHR-UHFFFAOYSA-N
XLogP3.39
TPSA90.05 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.55
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine with MolForge

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Related Compounds

2-[(3S)-1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-3-yl]-6-methyl-N-(3-methyl-2-pyridinyl)pyridin-4-amine
CID 95834977
N-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-3-yl]-6-methyl-4-pyridinyl]-4-methyl-1,3-thiazol-2-amine
CID 110093602
(2S)-2-(4-benzyl-6-methyl-2-pyridinyl)-4-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]morpholine
CID 124988726
(2S)-2-[4-[(4-fluorophenyl)methyl]-6-methyl-2-pyridinyl]-4-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]morpholine
CID 125002519
2-[4-[4-(2-aminopyrimidin-5-yl)-6-methyl-2-pyridinyl]piperidin-1-yl]-N-(4-methoxyphenyl)acetamide
CID 92617154
[3-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]piperidin-1-yl]-(2,6-dimethoxyphenyl)methanone
CID 110252448
1-[4-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]piperidin-1-yl]-2-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)ethanone
CID 92617268
2-methyl-5-[[4-(6-methylpyrazin-2-yl)piperidin-1-yl]methyl]pyrimidine
CID 118739889
2-[2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-N-cyclohexyl-N-methylacetamide
CID 127251351
[3-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]pyrrolidin-1-yl]-(2,3-dihydro-1,4-benzodioxin-6-yl)methanone
CID 110264819
2-[(2S)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-N-cyclohexyl-N-methylacetamide
CID 125015003
1-[4-[4-(2-aminopyrimidin-5-yl)-6-methyl-2-pyridinyl]piperidin-1-yl]-2-phenylethanone
CID 92618153

Frequently Asked Questions

What is the IUPAC name of 5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine?
The IUPAC name of 5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine (CID 92617305) is 5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine.
What is the SMILES notation for 5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine?
The canonical SMILES for 5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine is COCCc1ncc(CN2CCC(c3cc(-c4ccc(N)nc4)cc(C)n3)CC2)cn1.
What is the InChIKey of 5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine?
The InChIKey is FIYGJGFHFXJBHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N6O/c1-17-11-21(20-3-4-23(25)26-15-20)12-22(29-17)19-5-8-30(9-6-19)16-18-13-27-24(28-14-18)7-10-31-2/h3-4,11-15,19H,5-10,16H2,1-2H3,(H2,25,26).
What are the key properties of 5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine?
5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine has a molecular weight of 418.55 g/mol, XLogP of 3.39, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[1-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]piperidin-4-yl]-6-methyl-4-pyridinyl]pyridin-2-amine is sourced from PubChem (CID 92617305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).